Information card for entry 8100855

Structure parameters

• Formula: C28 H37 N3 O4
• Calculated formula: C55 H70 N6 O7
• Title of publication: Crystal structure of 1,3,5-tris(benzylamino)-1,3,5-trideoxy-cis-inositol— methanol (2/1), (C~6~H~5~CH~2~NH)~3~C~6~H~9~(OH)~3~ · 0.5CH~3~OH
• Authors of publication: Sander, J.; Huch, V.; Veith, M.; Hegetschweiler, K.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 1
• Pages of publication: 105 - 107
• a: 13.1 ± 0.003 Å
• b: 14.59 ± 0.003 Å
• c: 15.19 ± 0.003 Å
• α: 97.76 ± 0.03°
• β: 113.35 ± 0.03°
• γ: 101.9 ± 0.03°
• Cell volume: 2531.1 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No